6-methyl-2-(3-methyl-1,1-dioxo-1,4-thiazinan-4-yl)pyrimidine-4-carboximidamide

C11H17N5O2S — CID 107550721

IUPAC6-methyl-2-(3-methyl-1,1-dioxo-1,4-thiazinan-4-yl)pyrimidine-4-carboximidamide
SMILES[H]/N=C(\N)c1cc(C)nc(N2CCS(=O)(=O)CC2C)n1
InChIInChI=1S/C11H17N5O2S/c1-7-5-9(10(12)13)15-11(14-7)16-3-4-19(17,18)6-8(16)2/h5,8H,3-4,6H2,1-2H3,(H3,12,13)
InChIKeyZGTAZXDDEXYRJU-UHFFFAOYSA-N
MW283.36 g/mol
LogP-0.31
Rot. Bonds2

About 6-methyl-2-(3-methyl-1,1-dioxo-1,4-thiazinan-4-yl)pyrimidine-4-carboximidamide

6-methyl-2-(3-methyl-1,1-dioxo-1,4-thiazinan-4-yl)pyrimidine-4-carboximidamide (PubChem CID 107550721) has the molecular formula C11H17N5O2S and a molecular weight of 283.36 g/mol. Its IUPAC name is 6-methyl-2-(3-methyl-1,1-dioxo-1,4-thiazinan-4-yl)pyrimidine-4-carboximidamide.

Molecular Properties

Compound Name6-methyl-2-(3-methyl-1,1-dioxo-1,4-thiazinan-4-yl)pyrimidine-4-carboximidamide
PubChem CID107550721
Molecular FormulaC11H17N5O2S
Molecular Weight283.36 g/mol
Exact Mass283.11
IUPAC Name6-methyl-2-(3-methyl-1,1-dioxo-1,4-thiazinan-4-yl)pyrimidine-4-carboximidamide
SMILES[H]/N=C(\N)c1cc(C)nc(N2CCS(=O)(=O)CC2C)n1
InChIInChI=1S/C11H17N5O2S/c1-7-5-9(10(12)13)15-11(14-7)16-3-4-19(17,18)6-8(16)2/h5,8H,3-4,6H2,1-2H3,(H3,12,13)
InChIKeyZGTAZXDDEXYRJU-UHFFFAOYSA-N
XLogP-0.31
TPSA113.03 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.36
LogP ≤ 5-0.31
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}

Analyze 6-methyl-2-(3-methyl-1,1-dioxo-1,4-thiazinan-4-yl)pyrimidine-4-carboximidamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-(2,4-dimethylpiperidin-1-yl)-6-methylpyrimidine-4-carboximidamide
CID 107550425
3-(3-methyl-1,1-dioxo-1,4-thiazinan-4-yl)pyridazine-4-carboximidamide
CID 102883786
2-(3,4-dihydroxypyrrolidin-1-yl)-6-methylpyrimidine-4-carboximidamide
CID 107550744
6-(3-methyl-1,1-dioxo-1,4-thiazinan-4-yl)pyridine-3-carboximidamide
CID 102883784
6-methyl-2-thiomorpholin-4-ylpyrimidine-4-carboximidamide
CID 107550114
6-methyl-2-[methyl-(1-methylpiperidin-4-yl)amino]pyrimidine-4-carboximidamide
CID 107550091
2-(4-tert-butylpiperidin-1-yl)-6-methylpyrimidine-4-carboximidamide
CID 107550402
2-(4-ethylpiperidin-1-yl)-6-methylpyrimidine-4-carboximidamide
CID 107550246
6-methyl-2-[4-(trifluoromethyl)piperidin-1-yl]pyrimidine-4-carboximidamide
CID 107550566
2-(3-methyl-1,1-dioxo-1,4-thiazinan-4-yl)-6-methylsulfanylbenzenecarboximidamide
CID 102883781
2-imidazol-1-yl-6-methylpyrimidine-4-carboximidamide
CID 107550765
2-(3-cyclopropylpyrazol-1-yl)-6-methylpyrimidine-4-carboximidamide
CID 107550799

Frequently Asked Questions

What is the IUPAC name of 6-methyl-2-(3-methyl-1,1-dioxo-1,4-thiazinan-4-yl)pyrimidine-4-carboximidamide?
The IUPAC name of 6-methyl-2-(3-methyl-1,1-dioxo-1,4-thiazinan-4-yl)pyrimidine-4-carboximidamide (CID 107550721) is 6-methyl-2-(3-methyl-1,1-dioxo-1,4-thiazinan-4-yl)pyrimidine-4-carboximidamide.
What is the SMILES notation for 6-methyl-2-(3-methyl-1,1-dioxo-1,4-thiazinan-4-yl)pyrimidine-4-carboximidamide?
The canonical SMILES for 6-methyl-2-(3-methyl-1,1-dioxo-1,4-thiazinan-4-yl)pyrimidine-4-carboximidamide is [H]/N=C(\N)c1cc(C)nc(N2CCS(=O)(=O)CC2C)n1.
What is the InChIKey of 6-methyl-2-(3-methyl-1,1-dioxo-1,4-thiazinan-4-yl)pyrimidine-4-carboximidamide?
The InChIKey is ZGTAZXDDEXYRJU-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N5O2S/c1-7-5-9(10(12)13)15-11(14-7)16-3-4-19(17,18)6-8(16)2/h5,8H,3-4,6H2,1-2H3,(H3,12,13).
What are the key properties of 6-methyl-2-(3-methyl-1,1-dioxo-1,4-thiazinan-4-yl)pyrimidine-4-carboximidamide?
6-methyl-2-(3-methyl-1,1-dioxo-1,4-thiazinan-4-yl)pyrimidine-4-carboximidamide has a molecular weight of 283.36 g/mol, XLogP of -0.31, 2 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-2-(3-methyl-1,1-dioxo-1,4-thiazinan-4-yl)pyrimidine-4-carboximidamide is sourced from PubChem (CID 107550721), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).